6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine

C13H9ClFN3 — CID 117130371

IUPAC6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1cccc(Cc2nc3ccc(Cl)cn3n2)c1
InChIInChI=1S/C13H9ClFN3/c14-10-4-5-13-16-12(17-18(13)8-10)7-9-2-1-3-11(15)6-9/h1-6,8H,7H2
InChIKeyIJWDMHVVSJJYHQ-UHFFFAOYSA-N
MW261.69 g/mol
LogP3.11
Rot. Bonds2

About 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine

6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 117130371) has the molecular formula C13H9ClFN3 and a molecular weight of 261.69 g/mol. Its IUPAC name is 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID117130371
Molecular FormulaC13H9ClFN3
Molecular Weight261.69 g/mol
Exact Mass261.05
IUPAC Name6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1cccc(Cc2nc3ccc(Cl)cn3n2)c1
InChIInChI=1S/C13H9ClFN3/c14-10-4-5-13-16-12(17-18(13)8-10)7-9-2-1-3-11(15)6-9/h1-6,8H,7H2
InChIKeyIJWDMHVVSJJYHQ-UHFFFAOYSA-N
XLogP3.11
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.69
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-2-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117130343
6-chloro-2-[(3-methoxyphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117130393
6-chloro-2-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117130502
6-chloro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117130734
7-bromo-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117134987
6-chloro-2-propyl-[1,2,4]triazolo[1,5-a]pyridine
CID 117130665
6-chloro-3-[(3-fluorophenyl)methyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 51360074
2-[(3-chlorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117132609
2-[(4-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 82566629
4-chloro-2-[(3-fluorophenyl)methyl]pyrimidine
CID 61219333
2-[(3-bromophenyl)methyl]-6-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117130289
2-(6-chloro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-N,N-dimethylethanamine
CID 117130961

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 117130371) is 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine is Fc1cccc(Cc2nc3ccc(Cl)cn3n2)c1.
What is the InChIKey of 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is IJWDMHVVSJJYHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFN3/c14-10-4-5-13-16-12(17-18(13)8-10)7-9-2-1-3-11(15)6-9/h1-6,8H,7H2.
What are the key properties of 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine?
6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 261.69 g/mol, XLogP of 3.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 117130371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).